sodium 1-(1-sulfobutoxy)butane-1-sulfonic acid

Systemtic Name: sodium 1-(1-sulfobutoxy)butane-1-sulfonic acid Openeye Name: sodium 1-(1-sulfobutoxy)butane-1-sulfonic acid CAS Name: sodium 1-(1-sulfobutoxy)-1-butanesulfonic acid IUPAC Name: sodium 1-(1-sulfobutoxy)butane-1-sulfonic acid Traditional Name: sodium 1-(1-sulfobutoxy)butane-1-sulfonic acid Formula: C8H18NaO7S2+ MolecularWeight: 313.34409

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(OC(CCC)S(=O)(=O)O)S(=O)(=O)O.[Na+]

Isomeric SMILES

CCCC(OC(CCC)S(=O)(=O)O)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C8H18O7S2.Na/c1-3-5-7(16(9,10)11)15-8(6-4-2)17(12,13)14;/h7-8H,3-6H2,1-2H3,(H,9,10,11)(H,12,13,14);/q;+1